OTAVA-ZINC05553820 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -1.2530 1.1950 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -0.1500 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -0.8490 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -2.6240 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -1.9290 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.6910 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 0.0120 -2.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -0.6520 -3.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -1.8650 -3.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 0.1120 -4.8780 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7460 0.7270 -4.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 1.0080 -4.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -0.8310 -5.9950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -1.7030 -6.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -2.5560 -7.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -2.6210 -8.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -1.7580 -8.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -0.8320 -6.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -0.0540 -6.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -1.9660 -9.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -2.9180 -10.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -3.6640 -9.4500 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -3.3140 -11.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -4.1740 0.1390 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.9770 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 1.3520 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 1.2310 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -0.4300 2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -2.6280 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -2.3500 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 0.9770 -2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 0.3930 -4.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 1.5610 -5.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 1.7100 -4.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 -1.6870 -5.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 -1.3870 -9.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -2.7220 -12.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -4.3720 -11.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -3.1360 -11.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 M END